N-(5-chloro-2,4-dimethoxyphenyl)-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
N-(5-chloro-2,4-dimethoxyphenyl)-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
Compound characteristics
| Compound ID: | G290-0806 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide |
| Molecular Weight: | 469.95 |
| Molecular Formula: | C23 H20 Cl N3 O4 S |
| Smiles: | COc1cc(c(cc1NC(CCN1C(c2cccnc2Sc2ccccc12)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.0611 |
| logD: | 4.0055 |
| logSw: | -4.3449 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.144 |
| InChI Key: | WKUMYBISQUVSTI-UHFFFAOYSA-N |